Chemical Properties of 1,10-Decanediol (CAS 112-47-0)

InChI

InChI=1S/C10H22O2/c11-9-7-5-3-1-2-4-6-8-10-12/h11-12H,1-10H2

InChI Key

FOTKYAAJKYLFFN-UHFFFAOYSA-N

Formula

C10H22O2

SMILES

OCCCCCCCCCCO

Molecular Weight¹

174.28

CAS

112-47-0

Other Names

• 1,10-Decamethylene diol
• 1,10-Decamethylene glycol
• 1,10-Dihydroxydecane
• 1,6-Bis(2-hydroxyethyl)hexane
• Decamethylene glycol
• Decamethylenediol
• Decane-1,10-diol
• NSC 17165
• «alpha»,«omega»-Decanediol
• «alpha»,«omega»-Decanediol

• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_subH° : Enthalpy of sublimation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• P_vap : Vapor pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔcH°solid	[-6400.30; -6386.00]	kJ/mol
ΔcH°solid	-6400.30 ± 2.20	kJ/mol	NIST
ΔcH°solid	-6386.00 ± 3.00	kJ/mol	NIST
ΔfG°	-240.32	kJ/mol	Joback Calculated Property
ΔfH°gas	[-537.80; -523.10]	kJ/mol
ΔfH°gas	-523.10 ± 2.50	kJ/mol	NIST
ΔfH°gas	-537.80	kJ/mol	NIST
ΔfH°solid	[-693.58; -678.90]	kJ/mol
ΔfH°solid	-678.90 ± 2.30	kJ/mol	NIST
ΔfH°solid	-693.58	kJ/mol	NIST
ΔfusH°	44.96	kJ/mol	Measure...
ΔsubH°	[155.80; 155.80]	kJ/mol
ΔsubH°	155.80 ± 0.90	kJ/mol	NIST
ΔsubH°	155.80	kJ/mol	NIST
ΔsubH°	155.80 ± 0.90	kJ/mol	NIST
ΔvapH°	[113.70; 126.60]	kJ/mol
ΔvapH°	126.60 ± 4.20	kJ/mol	NIST
ΔvapH°	120.40 ± 4.90	kJ/mol	NIST
ΔvapH°	113.70 ± 2.10	kJ/mol	NIST
log10WS	-2.54		Crippen Calculated Property
logPoct/wat	2.092		Crippen Calculated Property
McVol	163.500	ml/mol	McGowan Calculated Property
Pc	2515.07	kPa	Joback Calculated Property
Inp	[1518.00; 1518.00]
Inp	1518.00		NIST
Inp	1518.00		NIST
Tboil	612.56	K	Joback Calculated Property
Tc	770.00	K	Critica...
Tfus	[343.30; 345.80]	K
Tfus	345.80	K	Thermod...
Tfus	345.70 ± 0.20	K	NIST
Tfus	345.80 ± 1.00	K	NIST
Tfus	344.15 ± 2.00	K	NIST
Tfus	343.30 ± 0.30	K	NIST
Tfus	345.40 ± 1.00	K	NIST
Ttriple	345.40 ± 0.10	K	NIST
Vc	0.633	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[441.57; 504.80]	J/mol×K	[612.56; 769.84]
Cp,gas	441.57	J/mol×K	612.56	Joback Calculated Property
Cp,gas	453.22	J/mol×K	638.77	Joback Calculated Property
Cp,gas	464.40	J/mol×K	664.99	Joback Calculated Property
Cp,gas	475.14	J/mol×K	691.20	Joback Calculated Property
Cp,gas	485.44	J/mol×K	717.42	Joback Calculated Property
Cp,gas	495.33	J/mol×K	743.63	Joback Calculated Property
Cp,gas	504.80	J/mol×K	769.84	Joback Calculated Property
η	[0.0000279; 0.0254585]	Pa×s	[324.10; 612.56]
η	0.0254585	Pa×s	324.10	Joback Calculated Property
η	0.0039246	Pa×s	372.18	Joback Calculated Property
η	0.0009280	Pa×s	420.25	Joback Calculated Property
η	0.0002950	Pa×s	468.33	Joback Calculated Property
η	0.0001161	Pa×s	516.41	Joback Calculated Property
η	0.0000536	Pa×s	564.48	Joback Calculated Property
η	0.0000279	Pa×s	612.56	Joback Calculated Property
ΔfusH	[41.70; 41.70]	kJ/mol	[345.50; 345.50]
ΔfusH	41.70	kJ/mol	345.50	NIST
ΔfusH	41.70	kJ/mol	345.50	NIST
ΔvapH	[112.40; 120.00]	kJ/mol	[298.15; 364.00]
ΔvapH	120.00	kJ/mol	298.15	Vaporiz...
ΔvapH	112.40	kJ/mol	364.00	NIST

Pressure Dependent Properties

Property	Value	Unit	Pressure (kPa)	Source
Tboilr	[443.00; 443.20]	K	[1.00; 1.00]
Tboilr	443.20	K	1.00	NIST
Tboilr	443.00	K	1.00	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.65]	kPa	[446.20; 555.20]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			2.12348e+01
Coefficient B			-7.23679e+03
Coefficient C			-1.00722e+02
Temperature range, min.			446.20
Temperature range, max.			555.20
Pvap	1.33	kPa	446.20	Calculated Property
Pvap	2.71	kPa	458.31	Calculated Property
Pvap	5.26	kPa	470.42	Calculated Property
Pvap	9.79	kPa	482.53	Calculated Property
Pvap	17.53	kPa	494.64	Calculated Property
Pvap	30.32	kPa	506.76	Calculated Property
Pvap	50.80	kPa	518.87	Calculated Property
Pvap	82.69	kPa	530.98	Calculated Property
Pvap	131.04	kPa	543.09	Calculated Property
Pvap	202.65	kPa	555.20	Calculated Property

Similar Compounds

Find more compounds similar to 1,10-Decanediol.

Sources

• Crippen Method
• Crippen Method
• Critical temperatures and pressures of straight-chain alkanediols (C3 to C12)
• Thermodynamics of fusion and sublimation for a homologous series of eleven alkane-.alpha.,.omega.-diols HO-(CH2)n-OH: Structure-related odd even effect
• Measurement of enthalpy curves of phase change materials via DSC and T-History: When are both methods needed to estimate the behaviour of the bulk material in applications?
• Vaporization Enthalpies of the r,o-Alkanediols by Correlation Gas Chromatography
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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